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2-Hydroxy-2-trifluoromethyl-3-(N-benzyl-N-acetylamido)-1,5-benzodiazepine-4-one
SpectraBase Compound ID GsSMYHVIxaE
InChI InChI=1S/C19H18F3N3O3/c1-12(26)25(11-13-7-3-2-4-8-13)16-17(27)23-14-9-5-6-10-15(14)24-18(16,28)19(20,21)22/h2-10,16,24,28H,11H2,1H3,(H,23,27)
InChIKey LOSSBGAKWSDDNR-UHFFFAOYSA-N
Mol Weight 393.37 g/mol
Molecular Formula C19H18F3N3O3
Exact Mass 393.130026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GLE5Vl9nuXp
Name 2-Hydroxy-2-trifluoromethyl-3-(N-benzyl-N-acetylamido)-1,5-benzodiazepine-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C19H18F3N3O3
InChI InChI=1S/C19H18F3N3O3/c1-12(26)25(11-13-7-3-2-4-8-13)16-17(27)23-14-9-5-6-10-15(14)24-18(16,28)19(20,21)22/h2-10,16,24,28H,11H2,1H3,(H,23,27)
InChIKey LOSSBGAKWSDDNR-UHFFFAOYSA-N
Molecular Weight 393.366 g/mol
SMILES N1c2c(NC(C(C1=O)N(C(=O)C)Cc1ccccc1)(C(F)(F)F)O)cccc2
SPLASH splash10-0006-9002000000-95165738870ba461bf20
Source of Spectrum O1-55-1923-3
Synonyms N-[4-hydroxy-2-oxo-4-(trifluoromethyl)-3,5-dihydro-1H-1,5-benzodiazepin-3-yl]-N-(phenylmethyl)acetamide N-benzyl-N-[4-hydroxy-2-oxo-4-(trifluoromethyl)-3,5-dihydro-1H-1,5-benzodiazepin-3-yl]acetamide N-[4-oxidanyl-2-oxidanylidene-4-(trifluoromethyl)-3,5-dihydro-1H-1,5-benzodiazepin-3-yl]-N-(phenylmethyl)ethanamide
Wiley ID 1591378